2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol

C12H14N4OS2 — CID 105120489

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol
SMILESCCCc1nnsc1C(O)Cc1cn2ccsc2n1
InChIInChI=1S/C12H14N4OS2/c1-2-3-9-11(19-15-14-9)10(17)6-8-7-16-4-5-18-12(16)13-8/h4-5,7,10,17H,2-3,6H2,1H3
InChIKeyKCAQXTHWCCVRIY-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.48
Rot. Bonds5

About 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol

2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol (PubChem CID 105120489) has the molecular formula C12H14N4OS2 and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol
PubChem CID105120489
Molecular FormulaC12H14N4OS2
Molecular Weight294.40 g/mol
Exact Mass294.06
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol
SMILESCCCc1nnsc1C(O)Cc1cn2ccsc2n1
InChIInChI=1S/C12H14N4OS2/c1-2-3-9-11(19-15-14-9)10(17)6-8-7-16-4-5-18-12(16)13-8/h4-5,7,10,17H,2-3,6H2,1H3
InChIKeyKCAQXTHWCCVRIY-UHFFFAOYSA-N
XLogP2.48
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(4-ethylthiadiazol-5-yl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 105174064
1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332851
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 104769476
2-(1-propan-2-ylpyrazol-3-yl)-1-(4-propylthiadiazol-5-yl)ethanol
CID 105103422
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methylphenyl)ethanol
CID 115332824
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-methylsulfanylphenyl)ethanol
CID 115828185
1-(4-butylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115828251
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methylsulfanylpropan-2-ol
CID 115333257
1-imidazo[2,1-b][1,3]thiazol-6-ylheptan-4-ol
CID 115334754
1-(2,5-dimethylthiophen-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332858
1-(dimethylamino)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
CID 115333340
6-(3-chloro-2-methylpentyl)imidazo[2,1-b][1,3]thiazole
CID 115334174

Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol (CID 105120489) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol is CCCc1nnsc1C(O)Cc1cn2ccsc2n1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol?
The InChIKey is KCAQXTHWCCVRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4OS2/c1-2-3-9-11(19-15-14-9)10(17)6-8-7-16-4-5-18-12(16)13-8/h4-5,7,10,17H,2-3,6H2,1H3.
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol?
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol has a molecular weight of 294.40 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol is sourced from PubChem (CID 105120489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).